ethyl 6-[[4-(2-methylsulfanylphenyl)piperazin-1-yl]carbonylamino]hexanoate

Systemtic Name: ethyl 6-[[4-(2-methylsulfanylphenyl)piperazin-1-yl]carbonylamino]hexanoate Openeye Name: ethyl 6-[[4-(2-methylsulfanylphenyl)piperazine-1-carbonyl]amino]hexanoate CAS Name: 6-[[[4-[2-(methylthio)phenyl]-1-piperazinyl]-oxomethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[[4-(2-methylsulfanylphenyl)piperazine-1-carbonyl]amino]hexanoate Traditional Name: 6-[[4-[2-(methylthio)phenyl]piperazine-1-carbonyl]amino]hexanoic acid ethyl ester Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCNC(=O)N1CCN(CC1)C2=CC=CC=C2SC

Isomeric SMILES

CCOC(=O)CCCCCNC(=O)N1CCN(CC1)C2=CC=CC=C2SC

InChI

InChI=1S/C20H31N3O3S/c1-3-26-19(24)11-5-4-8-12-21-20(25)23-15-13-22(14-16-23)17-9-6-7-10-18(17)27-2/h6-7,9-10H,3-5,8,11-16H2,1-2H3,(H,21,25)